3-Methyl-4-(3-thienyl)benzenamine
TL;DR: 3-Methyl-4-(3-thienyl)benzenamine (CAS 1026005-69-5) is a chemical compound with molecular formula C11H11NS and molecular weight 189.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-thiophen-3-ylaniline
Also Known As: 3-methyl-4-thiophen-3-yl-aniline, 3-Methyl-4-(3-thienyl)benzenamine
| Molecular Formula | C11H11NS |
|---|---|
| Molecular Weight | 189.06 g/mol |
| LogP | 3.30572 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.06122 |
| Heavy Atoms | 13 |
| Complexity | 404.03357 |
Chemical Identifiers
| CAS Number | 1026005-69-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N)C2=CSC=C2 |
Product Overview
3-Methyl-4-(3-thienyl)benzenamine (CAS 1026005-69-5), with molecular formula C11H11NS and molecular weight 189.06 g/mol. IUPAC: 3-methyl-4-thiophen-3-ylaniline.
Chemical Property Profile of 3-Methyl-4-(3-thienyl)benzenamine
Property Insights of 3-Methyl-4-(3-thienyl)benzenamine
The XLogP value of 3.30572 indicates that 3-Methyl-4-(3-thienyl)benzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 3-Methyl-4-(3-thienyl)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-4-(3-thienyl)benzenamine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methyl-4-(3-thienyl)benzenamine?
The CAS number of 3-Methyl-4-(3-thienyl)benzenamine is 1026005-69-5.
What is the molecular formula of 3-Methyl-4-(3-thienyl)benzenamine?
The molecular formula of 3-Methyl-4-(3-thienyl)benzenamine is C11H11NS.
What is the molecular weight of 3-Methyl-4-(3-thienyl)benzenamine?
The molecular weight of 3-Methyl-4-(3-thienyl)benzenamine is 189.06 g/mol.
Where can I buy 3-Methyl-4-(3-thienyl)benzenamine?
You can request a quote for 3-Methyl-4-(3-thienyl)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-4-(3-thienyl)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4-(3-thienyl)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.